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Benzenamine, 2-chloro-6-(methylsulfonyl)-4-nitro-

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

Benzenamine, 2-chloro-6-(methylsulfonyl)-4-nitro-
SpectraBase Compound ID H0VNLmANaws
InChI InChI=1S/C7H7ClN2O4S/c1-15(13,14)6-3-4(10(11)12)2-5(8)7(6)9/h2-3H,9H2,1H3
InChIKey ZQSXCLMTQGJVAA-UHFFFAOYSA-N
Mol Weight 250.66 g/mol
Molecular Formula C7H7ClN2O4S
Exact Mass 249.981506 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9Zv67W5De1G
Name Benzenamine, 2-chloro-6-(methylsulfonyl)-4-nitro-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 249.981505583 u
Formula C7H7ClN2O4S
InChI InChI=1S/C7H7ClN2O4S/c1-15(13,14)6-3-4(10(11)12)2-5(8)7(6)9/h2-3H,9H2,1H3
InChIKey ZQSXCLMTQGJVAA-UHFFFAOYSA-N
Molecular Weight 250.656 g/mol
SMILES CS(=O)(=O)C1=CC(=CC(=C1N)Cl)N(=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.973341